Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.81 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.81 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.51 |
| ▸ | MEN1 | O00255 | 5/20 | 0.51 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | CASP3 | P42574 | 1/20 | 0.51 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.51 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.51 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | CRHBP | P24387 | 1/20 | 0.48 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.48 |
| ▸ | SRC | P12931 | 1/20 | 0.46 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29365374 | 0.90 | ALDH1A1 (1.00) | ALDH1A1IMPDH2KMT2AMEN1RAB9A | |
| SCHEMBL378958 | 0.90 | ALDH1A1 (1.00) | ALDH1A1IMPDH2KMT2AMEN1RAB9A | |
| Water SCHEMBL27751444 | 0.88 | ALDH1A1 (0.96) | ALDH1A1IMPDH2KMT2AMEN1RAB9A | |
| Bromobenzene SCHEMBL27728887 | 0.84 | ALDH1A1 (0.81) | ALDH1A1IMPDH2KMT2AMEN1RAB9A | |
| Fluorobenzene SCHEMBL27749295 | 0.84 | ALDH1A1 (0.81) | ALDH1A1IMPDH2KMT2AMEN1RAB9A | |
| Glycine SCHEMBL8212710 | 0.80 | ALDH1A1 (0.73) | ALDH1A1IMPDH2KMT2AMEN1RAB9A | |
| SCHEMBL7529789 | 0.79 | ALDH1A1 (0.78) | ALDH1A1IMPDH2KMT2AMEN1RAB9A | |
| SCHEMBL29577068 | 0.78 | ALDH1A1 (0.77) | ALDH1A1IMPDH2KMT2AMEN1RAB9A | |
| SCHEMBL11096672 | 0.78 | ALDH1A1 (0.77) | ALDH1A1IMPDH2KMT2AMEN1RAB9A | |
| SCHEMBL28981744 | 0.78 | ALDH1A1 (0.69) | ALDH1A1IMPDH2KMT2AMEN1RAB9A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101360422-B | Oncogenic Ras-specific cytotoxic compound and methods of usethereof | UNIV TEXAS | 2013-10-23 | — | — | CN | disclosed |
| CN-101360422-A | Oncogenic ras-specific cytotoxic compound and methods of usethereof | UNIV TEXAS (US) | 2009-02-04 | — | — | CN | disclosed |